2-pyrimidin-2-ylsulfanyl-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-pyrimidin-2-ylsulfanyl-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-pyrimidin-2-ylsulfanyl-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]acetamide CAS Name: 2-(2-pyrimidinylthio)-N-[2-(1-pyrrolidinyl)-5-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-pyrimidin-2-ylsulfanyl-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-(2-pyrimidylthio)-N-[2-pyrrolidino-5-(trifluoromethyl)phenyl]acetamide Formula: C17H17F3N4OS MolecularWeight: 382.40329

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSC3=NC=CC=N3

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C17H17F3N4OS/c18-17(19,20)12-4-5-14(24-8-1-2-9-24)13(10-12)23-15(25)11-26-16-21-6-3-7-22-16/h3-7,10H,1-2,8-9,11H2,(H,23,25)